2-(4-bromophenyl)-9-(4-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydropyrazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
2-(4-bromophenyl)-9-(4-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydropyrazolo[5,1-b]quinazolin-8(4H)-one
2-(4-bromophenyl)-9-(4-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydropyrazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | C202-4067 |
| Compound Name: | 2-(4-bromophenyl)-9-(4-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydropyrazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 482.81 |
| Molecular Formula: | C24 H21 Br Cl N3 O |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)[Cl])n3c(cc(c4ccc(cc4)[Br])n3)N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7423 |
| logD: | 6.7416 |
| logSw: | -6.4406 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.711 |
| InChI Key: | YMNWNZRBWLZZRN-QHCPKHFHSA-N |